BAS 03305312
TL;DR: BAS 03305312 (CAS 431926-95-3) is a chemical compound with molecular formula C26H21FN2O4 and molecular weight 444.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E)-4-[(4-fluorophenyl)-hydroxymethylidene]-5-(4-prop-2-enoxyphenyl)-1-(pyridin-3-ylmethyl)pyrrolidine-2,3-dione
Also Known As: BAS 03305312, 4-(4-fluorobenzoyl)-3-hydroxy-5-[4-(prop-2-en-1-yloxy)phenyl]-1-[(pyridin-3-yl)methyl]-2,5-dihydro-1H-pyrrol-2-one, (4E)-4-[(4-fluorophenyl)-hydroxymethylidene]-5-(4-prop-2-enoxyphenyl)-1-(pyridin-3-ylmethyl)pyrrolidine-2,3-dione, 4-[(4-fluorophenyl)carbonyl]-3-hydroxy-5-[4-(prop-2-en-1-yloxy)phenyl]-1-(pyridin-3-ylmethyl)-1,5-dihydro-2H-pyrrol-2-one
| Molecular Formula | C26H21FN2O4 |
|---|---|
| Molecular Weight | 444.15 g/mol |
| LogP | 4.4074 |
| Topological Polar Surface Area | 79.73 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 444.14853 |
| Heavy Atoms | 33 |
| Complexity | 1205.304 |
Chemical Identifiers
| CAS Number | 431926-95-3 |
|---|---|
| SMILES | C=CCOC1=CC=C(C=C1)C2/C(=C(/C3=CC=C(C=C3)F)\O)/C(=O)C(=O)N2CC4=CN=CC=C4 |
Product Overview
BAS 03305312 (CAS 431926-95-3), with molecular formula C26H21FN2O4 and molecular weight 444.15 g/mol. IUPAC: (4E)-4-[(4-fluorophenyl)-hydroxymethylidene]-5-(4-prop-2-enoxyphenyl)-1-(pyridin-3-ylmethyl)pyrrolidine-2,3-dione.
Chemical Property Profile of BAS 03305312
Property Insights of BAS 03305312
The XLogP value of 4.4074 indicates that BAS 03305312 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.73 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 03305312. Following Lipinski's Rule of Five, BAS 03305312 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 03305312?
The CAS number of BAS 03305312 is 431926-95-3.
What is the molecular formula of BAS 03305312?
The molecular formula of BAS 03305312 is C26H21FN2O4.
What is the molecular weight of BAS 03305312?
The molecular weight of BAS 03305312 is 444.15 g/mol.
Where can I buy BAS 03305312?
You can request a quote for BAS 03305312 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 03305312?
Yes, KEHONG BIO provides custom synthesis services for BAS 03305312 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.